11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]

C383H243N17S2 — CID 160978877

About 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]

11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine] (PubChem CID 160978877) has the molecular formula C383H243N17S2 and a molecular weight of 5147.41 g/mol. Its IUPAC name is 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine].

Molecular Properties

• Compound Name: 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]
• PubChem CID: 160978877
• Molecular Formula: C383H243N17S2
• Molecular Weight: 5147.41 g/mol
• Exact Mass: 5142.90
• IUPAC Name: 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]
• SMILES: c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5cccc(-c6ccc(-c7ccccc7)cc6)c5)c5ccccc5N(c5ccccc5)c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5ccccc5)c5ccccc5N(c5ccccc5)c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5ccccc5)c5ccccc5N(c5ccccc5)c5ccccc54)c3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccc3sc5ccccc5c3c2)sc2cc3c(cc24)c2ccccc2n3-c2ccccc2)cc1.c1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5ccccc5)c5ccccc5N(c5ccccc5)c5ccccc54)c3)c2)cc1.c1ccc(N2c3ccccc3C3(c4cc5c(cc4-c4cc6c7ccccc7n(-c7ccccc7)c6cc43)c3ccccc3n5-c3ccccc3)c3ccccc32)cc1
• InChI: InChI=1S/C79H51N3.3C67H43N3.C55H35N3.C48H28N2S2/c1-4-19-52(20-5-1)54-35-37-56(38-36-54)57-43-45-61(46-44-57)80-73-31-14-10-27-63(73)67-48-65-66-49-68-64-28-11-15-32-74(64)82(62-26-18-23-59(47-62)58-41-39-55(40-42-58)53-21-6-2-7-22-53)78(68)51-72(66)79(71(65)50-77(67)80)69-29-12-16-33-75(69)81(60-24-8-3-9-25-60)76-34-17-13-30-70(76)79;1-4-20-44(21-5-1)45-22-18-23-46(38-45)47-24-19-29-50(39-47)70-62-35-15-11-31-52(62)56-41-54-53-40-55-51-30-10-14-34-61(51)68(48-25-6-2-7-26-48)65(55)42-59(53)67(60(54)43-66(56)70)57-32-12-16-36-63(57)69(49-27-8-3-9-28-49)64-37-17-13-33-58(64)67;1-4-19-44(20-5-1)45-35-37-46(38-36-45)47-21-18-26-50(39-47)70-62-32-15-11-28-52(62)56-41-54-53-40-55-51-27-10-14-31-61(51)68(48-22-6-2-7-23-48)65(55)42-59(53)67(60(54)43-66(56)70)57-29-12-16-33-63(57)69(49-24-8-3-9-25-49)64-34-17-13-30-58(64)67;1-4-18-44(19-5-1)45-32-34-46(35-33-45)47-36-38-50(39-37-47)69-62-29-15-11-25-52(62)56-41-54-53-40-55-51-24-10-14-28-61(51)68(48-20-6-2-7-21-48)65(55)42-59(53)67(60(54)43-66(56)69)57-26-12-16-30-63(57)70(49-22-8-3-9-23-49)64-31-17-13-27-58(64)67;1-4-18-36(19-5-1)56-49-28-14-10-24-39(49)43-32-41-42-33-44-40-25-11-15-29-50(40)57(37-20-6-2-7-21-37)54(44)35-48(42)55(47(41)34-53(43)56)45-26-12-16-30-51(45)58(38-22-8-3-9-23-38)52-31-17-13-27-46(52)55;1-3-11-29(12-4-1)30-19-21-42-35(23-30)37-26-40-39-25-36-33-15-7-9-17-41(33)49(31-13-5-2-6-14-31)43(36)27-47(39)52-48(40)28-44(37)50(42)32-20-22-46-38(24-32)34-16-8-10-18-45(34)51-46/h1-51H;3*1-43H;1-35H;1-28H
• InChIKey: SZGAMYDRXSROOE-UHFFFAOYSA-N
• XLogP: 101.09
• TPSA: 75.36 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 28
• Heavy Atoms: 402
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5147.41
LogP ≤ 5	101.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]?

The IUPAC name of 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine] (CID 160978877) is 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine].

What is the SMILES notation for 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]?

The canonical SMILES for 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine] is c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5cccc(-c6ccc(-c7ccccc7)cc6)c5)c5ccccc5N(c5ccccc5)c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5ccccc5)c5ccccc5N(c5ccccc5)c5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5ccccc5)c5ccccc5N(c5ccccc5)c5ccccc54)c3)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccc3sc5ccccc5c3c2)sc2cc3c(cc24)c2ccccc2n3-c2ccccc2)cc1.c1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5cc6c(cc54)C4(c5cc7c(cc5-6)c5ccccc5n7-c5ccccc5)c5ccccc5N(c5ccccc5)c5ccccc54)c3)c2)cc1.c1ccc(N2c3ccccc3C3(c4cc5c(cc4-c4cc6c7ccccc7n(-c7ccccc7)c6cc43)c3ccccc3n5-c3ccccc3)c3ccccc32)cc1.

What is the InChIKey of 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]?

The InChIKey is SZGAMYDRXSROOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C79H51N3.3C67H43N3.C55H35N3.C48H28N2S2/c1-4-19-52(20-5-1)54-35-37-56(38-36-54)57-43-45-61(46-44-57)80-73-31-14-10-27-63(73)67-48-65-66-49-68-64-28-11-15-32-74(64)82(62-26-18-23-59(47-62)58-41-39-55(40-42-58)53-21-6-2-7-22-53)78(68)51-72(66)79(71(65)50-77(67)80)69-29-12-16-33-75(69)81(60-24-8-3-9-25-60)76-34-17-13-30-70(76)79;1-4-20-44(21-5-1)45-22-18-23-46(38-45)47-24-19-29-50(39-47)70-62-35-15-11-31-52(62)56-41-54-53-40-55-51-30-10-14-34-61(51)68(48-25-6-2-7-26-48)65(55)42-59(53)67(60(54)43-66(56)70)57-32-12-16-36-63(57)69(49-27-8-3-9-28-49)64-37-17-13-33-58(64)67;1-4-19-44(20-5-1)45-35-37-46(38-36-45)47-21-18-26-50(39-47)70-62-32-15-11-28-52(62)56-41-54-53-40-55-51-27-10-14-31-61(51)68(48-22-6-2-7-23-48)65(55)42-59(53)67(60(54)43-66(56)70)57-29-12-16-33-63(57)69(49-24-8-3-9-25-49)64-34-17-13-30-58(64)67;1-4-18-44(19-5-1)45-32-34-46(35-33-45)47-36-38-50(39-37-47)69-62-29-15-11-25-52(62)56-41-54-53-40-55-51-24-10-14-28-61(51)68(48-20-6-2-7-21-48)65(55)42-59(53)67(60(54)43-66(56)69)57-26-12-16-30-63(57)70(49-22-8-3-9-23-49)64-31-17-13-27-58(64)67;1-4-18-36(19-5-1)56-49-28-14-10-24-39(49)43-32-41-42-33-44-40-25-11-15-29-50(40)57(37-20-6-2-7-21-37)54(44)35-48(42)55(47(41)34-53(43)56)45-26-12-16-30-51(45)58(38-22-8-3-9-23-38)52-31-17-13-27-46(52)55;1-3-11-29(12-4-1)30-19-21-42-35(23-30)37-26-40-39-25-36-33-15-7-9-17-41(33)49(31-13-5-2-6-14-31)43(36)27-47(39)52-48(40)28-44(37)50(42)32-20-22-46-38(24-32)34-16-8-10-18-45(34)51-46/h1-51H;3*1-43H;1-35H;1-28H.

What are the key properties of 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine]?

11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine] has a molecular weight of 5147.41 g/mol, XLogP of 101.09, 28 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 11-dibenzothiophen-2-yl-7,19-diphenyl-15-thia-11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5(10),6,8,12,17,20,22,24,26-dodecaene;10',11-diphenyl-19-[3-(3-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[3-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11-diphenyl-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10'-phenyl-11-[3-(4-phenylphenyl)phenyl]-19-[4-(4-phenylphenyl)phenyl]spiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine];10',11,19-triphenylspiro[11,19-diazaheptacyclo[14.11.0.02,14.04,12.05,10.018,26.020,25]heptacosa-1(16),2(14),3,5,7,9,12,17,20,22,24,26-dodecaene-15,9'-acridine] is sourced from PubChem (CID 160978877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).